! wb97x-d3
! def2-TZVPP
! def2/J RIJCOSX GRIDX6 NOFINALGRIDX
! grid4 nofinalgrid
! scfconv7
! smallprint printgap noloewdin
! NOSOSCF
%MaxCore 8000
%output
       print[P_BondOrder_M] 1
       print[P_Mayer] 1
       print[P_basis] 2
end
%pal
    nprocs 8
end
%cpcm
    smd    true
    smdsolvent "WATER"
end
*xyz 0 1
Cl  -0.9921106647   0.2772739636  -2.5399040272
Cl  -4.9275475383   2.8591085706  -0.0215936114
F    3.0213612577  -0.1226063496  -1.3988425804
F    4.0516036888   1.4818417806  -0.3878032232
F    4.2347510165  -1.9632713927   0.2426976536
F    5.2945888256  -0.3469188355   1.2616228099
O    2.6650575521   0.1905138362   0.7882084116
N   -0.8868776012  -2.1401199372   1.0169832376
N   -0.9484018269  -2.8739598841  -0.0959772252
N   -2.8723976310  -3.0229871297   1.0499438984
C    0.3027828825  -0.1315983380   0.2646744265
C    0.2335785557  -1.2721412255   1.2857920398
C    1.4065407409   0.8618478970   0.6174685897
C   -1.0046570567   0.6140325240   0.1639545983
C   -1.6619141027   0.8380326734  -1.0438358114
C   -1.6061241432   1.1270370287   1.3122132439
C    3.5579424486   0.2305920928  -0.2031444504
C   -2.8666872380   1.5225780658  -1.1136917052
C   -2.8040878258   1.8177845658   1.2767782422
C   -2.0412363602  -2.2263463948   1.6769304383
C   -3.4273705556   2.0052994563   0.0546377496
C    4.7233593347  -0.7117408279   0.0927263406
C   -2.1504980589  -3.3841894826  -0.0262134017
H    0.5323121121  -0.5758607934  -0.7037191048
H    1.1482832872  -1.8617890130   1.2581350612
H    0.1230514934  -0.9005100546   2.3043051525
H    1.4659453129   1.6453640539  -0.1402635043
H    1.2042889835   1.3487342194   1.5718190419
H   -1.1299056194   0.9881057437   2.2748335085
H   -3.3544468262   1.6759059684  -2.0660740548
H   -3.2397387024   2.1999908951   2.1889356546
H   -2.2248899624  -1.7165113323   2.6094026460
H    5.4707216572  -0.7014208429  -0.7014261282
H   -2.5226878478  -4.0524323675  -0.7867577568
*
